%chk=000282615.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000282615

0 1
O 5.498156 -0.579491 -1.571401
O 6.662028 0.006780 0.412369
N 0.384478 -0.021189 0.022286
N -1.583411 1.252285 -0.053549
C -1.785231 -1.209859 0.100150
C -3.195768 -1.114180 0.018376
C -1.014901 0.044965 0.046114
C -3.815790 0.194027 -0.117226
C 1.167777 1.243698 0.116416
C 2.634432 0.922309 0.247878
C -2.976778 1.339132 -0.153056
C -1.176695 -2.482154 0.222027
C -3.965689 -2.306859 0.071227
C 3.288436 0.285387 -0.841425
C 4.628252 0.028322 -0.675778
C 5.328851 0.380175 0.518511
C -5.218101 0.380171 -0.215571
C 3.320782 1.260279 1.414006
C -3.544124 2.639683 -0.283939
C 4.701596 0.996425 1.576586
C -1.945410 -3.630432 0.270374
C -3.353051 -3.538834 0.195200
C -5.757208 1.645313 -0.342474
C -4.912258 2.781436 -0.376650
C 6.807791 -0.601999 -0.913260
H 0.802784 1.882940 0.956136
H 0.972587 1.841334 -0.810660
H 0.825328 -0.836948 0.443485
H -0.090030 -2.559891 0.272051
H -5.052571 -2.237647 0.010849
H 2.748956 0.022792 -1.749034
H 2.792847 1.747204 2.234789
H -5.870886 -0.493652 -0.190270
H -2.875072 3.499791 -0.309375
H 5.228807 1.267964 2.486565
H -1.476193 -4.607955 0.363542
H -3.949561 -4.450402 0.234644
H -6.833474 1.782590 -0.418001
H -5.358374 3.770522 -0.478033
H 7.490913 0.026442 -1.499815
H 7.095775 -1.651874 -0.771966


%chk=000282615-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000282615

0 1
O 4.354412 -0.114818 -2.117630
O 6.293321 0.302306 -0.769558
N 0.270239 -0.191863 1.426517
N -1.364439 1.106565 0.384176
C -1.779805 -1.320383 0.628917
C -3.055371 -1.189735 -0.026407
C -0.966413 -0.101585 0.803204
C -3.487780 0.133362 -0.483974
C 1.145249 0.967501 1.656569
C 2.537648 0.785430 1.061946
C -2.598834 1.242971 -0.248992
C -1.353856 -2.604121 1.080726
C -3.848989 -2.363730 -0.201769
C 2.673554 0.397876 -0.306091
C 3.967153 0.284229 -0.811083
C 5.110794 0.531728 -0.018171
C -4.727686 0.380495 -1.142311
C 3.688688 1.024116 1.851298
C -2.977454 2.550785 -0.677451
C 5.005065 0.901713 1.322654
C -2.152660 -3.741265 0.896199
C -3.411317 -3.616386 0.247857
C -5.085060 1.672394 -1.557251
C -4.202366 2.765391 -1.322642
C 5.824027 0.101366 -2.166434
H 1.231500 1.172312 2.742615
H 0.620802 1.825220 1.197036
H 0.612941 -1.103516 1.721578
H -0.389623 -2.731381 1.586166
H -4.821258 -2.289483 -0.697682
H 1.794197 0.204624 -0.926615
H 3.566273 1.316781 2.900476
H -5.422053 -0.444585 -1.332931
H -2.277280 3.368973 -0.482792
H 5.891162 1.083014 1.936008
H -1.809297 -4.719234 1.249544
H -4.040188 -4.501109 0.100428
H -6.042827 1.840049 -2.061617
H -4.482794 3.773628 -1.647633
H 6.034548 1.016372 -2.752314
H 6.305779 -0.797407 -2.580469


